2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]ethanamide

Systemtic Name: 2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]ethanamide Openeye Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide CAS Name: 2-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]thio]-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]acetamide IUPAC Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Traditional Name: 2-[(4-benzyl-5-methyl-1H-imidazol-2-yl)thio]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]acetamide Formula: C24H30N5OS+ MolecularWeight: 436.5929

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SCC(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(N1)SCC(=O)NC2=CC=C(C=C2)N3CC[NH+](CC3)C)CC4=CC=CC=C4

InChI

InChI=1S/C24H29N5OS/c1-18-22(16-19-6-4-3-5-7-19)27-24(25-18)31-17-23(30)26-20-8-10-21(11-9-20)29-14-12-28(2)13-15-29/h3-11H,12-17H2,1-2H3,(H,25,27)(H,26,30)/p+1